1-[(Z)-(5-methylfuran-2-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(Z)-(5-methylfuran-2-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(Z)-(5-methyl-2-furyl)methyleneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(Z)-(5-methyl-2-furanyl)methylideneamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(Z)-(5-methylfuran-2-yl)methylideneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(Z)-(5-methyl-2-furyl)methyleneamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C14H23N4O2S+ MolecularWeight: 311.42302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=NNC(=S)NCCC[NH+]2CCOCC2

Isomeric SMILES

CC1=CC=C(O1)/C=N\NC(=S)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C14H22N4O2S/c1-12-3-4-13(20-12)11-16-17-14(21)15-5-2-6-18-7-9-19-10-8-18/h3-4,11H,2,5-10H2,1H3,(H2,15,17,21)/p+1/b16-11-